Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03521633
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
| Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
|---|---|---|---|---|---|
| Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
7DE | 3,5-DIMETHYL-1-(3-NITROPHENYL)- 1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER | A,B | 1Y2J | 0.71 |  |
| 7DE | 3,5-DIMETHYL-1-(3-NITROPHENYL)- 1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER | A,B | 1Y2K | 0.71 | |
116 | 7-[4-(4-FLUORO-PHENYL)-5-HYDROXYMETHYL- 2,6-DIISOPROPYL-PYRIDIN-3-YL]-3,5- DIHYDROXY-HEPTANOIC ACID | A,B,C,D | 1HWJ | 0.78 | |
CBB | 1-(3-CARBAMIMIDOYL-BENZYL)-1H-INDOLE- 2-CARBOXYLIC ACID 3-CARBAMIMIDOYL- BENZYLESTER | B | 1LPK | 0.71 | |
BRF | A | 1UUO | 0.73 | | |
8CA | 9-benzyl-2,3,4,9-tetrahydro-1H- carbazole-8-carboxylic acid | A | 3FR2 | 0.71 | |
225 | FELODIPINE | A | 2NNJ | 0.85 | |
QUA | 8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID | C | 2JQ7 | 0.73 | |
| QUA | 8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID | B | 1OLN | 0.73 | |
| QUA | 8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID | A | 1E9W | 0.73 | |
DPY | A,B | 1JES | 0.71 | | |
1IQ | 2-(4-ISOPROPYL-4-METHYL-5-OXO-4,5- DIHYDRO-1H-IMIDAZOL-2-YL)QUINOLINE- 3-CARBOXYLIC ACID | A | 1Z8N | 0.76 | |
LG2 | 6-[1-(3,5,5,8,8-PENTAMETHYL-5,6,7,8- TETRAHYDRONAPHTHALEN-2-YL)CYCLOPROPYL]PYRIDINE- 3-CARBOXYLIC ACID | A,B,C,D | 1H9U | 0.76 | |
ONO | 2-[2-({[4-(DIAMINOMETHYL)PHENYL]AMINO}CARBONYL)- 6-METHOXYPYRIDIN-3-YL]-5-{[(1-FORMYL- 2,2-DIMETHYLPROPYL)AMINO]CARBONYL}BENZOIC ACID | A | 2AYW | 0.71 | |
BRE | 2-BIPHENYL-4-YL-6-FLUORO-3-METHYL- QUINOLINE-4-CARBOXYLIC ACID | A | 1D3G | 0.74 | |
QND | QUINALDIC ACID | A,B | 1IDA | 0.73 | |
550 | methyl (1R,2S)-2-(hydroxycarbamoyl)- 1-{4-[(2-methylquinolin-4-yl)methoxy]benzyl}cyclopropanecarboxylate | A,B | 3EDZ | 0.7 | |
936 | 5-METHOXY-1,2-DIMETHYL-3-(4-NITROPHENOXYMETHYL)INDOLE- 4,7-DIONE | A,B,C,D | 1KBQ | 0.72 | |
IMM | 1-(4-IODOBENZOYL)-5-METHOXY-2-METHYL INDOLE- 3-ACETIC ACID | A,B | 1PGF | 0.71 | |
| IMM | 1-(4-IODOBENZOYL)-5-METHOXY-2-METHYL INDOLE- 3-ACETIC ACID | A,B | 1PGG | 0.71 | |
ARH | 3-(HYDROXYMETHYL)-1-METHYL-5-(2- METHYLAZIRIDIN-1-YL)-2-PHENYL-1H- INDOLE-4,7-DIONE | A,B,C,D | 1H69 | 0.7 | |
BIN | 2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM | A | 1C8L | 0.78 | |
| BIN | 2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM | A | 2AMV | 0.78 | |
| BIN | 2,3-DICARBOXY-4-(2-CHLORO-PHENYL)- 1-ETHYL-5-ISOPROPOXYCARBONYL-6- METHYL-PYRIDINIUM | A | 3AMV | 0.78 | |
PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1CQ1 | 0.71 | |
| PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1OTW | 0.71 | |
| PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1C9U | 0.71 | |
| PQQ | PYRROLOQUINOLINE QUINONE | A,C | 1W6S | 0.71 | |
| PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1FLG | 0.71 | |
| PQQ | PYRROLOQUINOLINE QUINONE | A | 1KV9 | 0.71 | |
| PQQ | PYRROLOQUINOLINE QUINONE | A,C | 2AD6 | 0.71 | |
| PQQ | PYRROLOQUINOLINE QUINONE | A,B | 1CRU | 0.71 | |
| PQQ | PYRROLOQUINOLINE QUINONE | A,C | 1H4I | 0.71 | |
| PQQ | PYRROLOQUINOLINE QUINONE | A,C | 2AD7 | 0.71 | |
| PQQ | PYRROLOQUINOLINE QUINONE | A,C | 2AD8 | 0.71 | |
| PQQ | PYRROLOQUINOLINE QUINONE | A,D,I | 2D0V | 0.71 | |
| PQQ | PYRROLOQUINOLINE QUINONE | A,C | 4AAH | 0.71 | |
| PQQ | PYRROLOQUINOLINE QUINONE | A,C,E,G | 1H4J | 0.71 | |
| PQQ | PYRROLOQUINOLINE QUINONE | A | 1KB0 | 0.71 | |
| PQQ | PYRROLOQUINOLINE QUINONE | A | 1YIQ | 0.71 | |
| PQQ | PYRROLOQUINOLINE QUINONE | A,C | 1LRW | 0.71 | |
| PQQ | PYRROLOQUINOLINE QUINONE | A,C | 1G72 | 0.71 | |